==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 07-MAR-11 3R06 . COMPND 2 MOLECULE: ANTI-MOUSE CD3EPSILON ANTIBODY 2C11 FAB LIGHT CHA . SOURCE 2 ORGANISM_SCIENTIFIC: CRICETULUS MIGRATORIUS; . AUTHOR D.A.SHORE,X.ZHU,I.A.WILSON . 1695 12 16 16 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 78100.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1061 62.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 685 40.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 8 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 16 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 141 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 128 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 42 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 4 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 10 11 29 8 18 32 6 0 8 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 4 16 4 0 4 0 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A D 0 0 121 0, 0.0 2,-0.5 0, 0.0 95,-0.1 0.000 360.0 360.0 360.0 103.9 -8.6 -2.6 -27.6 2 2 A I - 0 0 4 93,-0.4 2,-0.5 91,-0.2 88,-0.1 -0.694 360.0-138.8 -78.4 122.4 -5.7 -0.9 -29.4 3 3 A Q - 0 0 121 -2,-0.5 23,-0.9 94,-0.0 2,-0.5 -0.763 11.3-149.9 -90.2 123.8 -3.6 0.9 -26.8 4 4 A M E -A 25 0A 13 -2,-0.5 2,-0.3 94,-0.3 21,-0.2 -0.804 9.1-160.6 -95.7 126.5 -2.3 4.4 -27.8 5 5 A T E -A 24 0A 80 19,-3.6 19,-2.8 -2,-0.5 2,-0.4 -0.868 2.4-162.1-106.6 140.0 1.0 5.6 -26.4 6 6 A Q E -A 23 0A 16 -2,-0.3 17,-0.2 17,-0.2 -2,-0.0 -0.974 11.1-137.7-129.3 122.8 2.1 9.3 -26.3 7 7 A S E S+A 22 0A 63 15,-2.1 15,-3.0 -2,-0.4 2,-0.1 -0.984 75.9 24.1-128.3 136.3 5.6 10.6 -25.8 8 8 A P - 0 0 43 0, 0.0 3,-0.1 0, 0.0 14,-0.1 0.616 63.2-154.6 -81.1 175.5 6.6 12.9 -24.1 9 9 A S S S+ 0 0 93 1,-0.3 94,-2.2 93,-0.1 2,-0.3 0.893 87.4 18.2 -75.3 -41.1 4.1 13.4 -21.3 10 10 A S E -d 103 0B 57 92,-0.2 -1,-0.3 2,-0.0 94,-0.2 -0.989 68.6-163.8-131.5 139.5 5.1 17.1 -20.9 11 11 A L E -d 104 0B 39 92,-2.8 94,-2.6 -2,-0.3 2,-0.3 -0.879 4.9-159.5-128.7 100.0 7.0 19.3 -23.5 12 12 A P E +d 105 0B 58 0, 0.0 2,-0.3 0, 0.0 94,-0.2 -0.585 29.1 156.4 -76.9 134.2 8.6 22.6 -22.3 13 13 A A E -d 106 0B 4 92,-2.2 94,-2.4 -2,-0.3 2,-0.3 -0.955 36.6-117.9-151.8 168.9 9.2 25.0 -25.3 14 14 A S > - 0 0 49 -2,-0.3 3,-1.7 92,-0.2 64,-0.3 -0.761 43.6 -87.3-111.9 157.1 9.7 28.6 -26.3 15 15 A L T 3 S+ 0 0 101 -2,-0.3 64,-0.2 1,-0.2 3,-0.1 -0.432 115.3 24.8 -65.4 135.6 7.5 30.8 -28.6 16 16 A G T 3 S+ 0 0 40 62,-2.4 -1,-0.2 1,-0.3 2,-0.1 0.232 94.2 132.9 91.9 -8.8 8.6 30.4 -32.2 17 17 A D < - 0 0 71 -3,-1.7 61,-2.1 60,-0.2 2,-0.5 -0.409 62.6-117.0 -74.6 150.3 10.1 26.9 -31.7 18 18 A R - 0 0 172 59,-0.2 2,-0.4 -2,-0.1 58,-0.2 -0.769 38.2-164.7 -85.1 125.1 9.5 23.9 -33.9 19 19 A V E - B 0 75A 7 56,-2.8 56,-2.3 -2,-0.5 2,-0.4 -0.968 11.8-170.0-123.0 131.8 7.7 21.3 -31.7 20 20 A T E - B 0 74A 52 -2,-0.4 2,-0.3 54,-0.2 54,-0.2 -0.981 1.1-170.8-127.2 120.1 7.2 17.5 -32.3 21 21 A I E - B 0 73A 0 52,-2.5 52,-2.5 -2,-0.4 2,-0.3 -0.833 17.7-139.9-102.6 144.4 5.0 15.1 -30.3 22 22 A N E -AB 7 72A 74 -15,-3.0 -15,-2.1 -2,-0.3 2,-0.4 -0.856 13.0-166.6-113.7 144.2 5.1 11.3 -30.9 23 23 A a E -AB 6 71A 4 48,-3.3 48,-2.7 -2,-0.3 2,-0.4 -0.984 1.7-169.5-127.2 134.9 2.3 8.8 -31.0 24 24 A Q E -AB 5 70A 92 -19,-2.8 -19,-3.6 -2,-0.4 2,-0.3 -0.994 7.9-153.7-132.8 127.1 2.5 4.9 -30.9 25 25 A A E -A 4 0A 2 44,-2.3 -21,-0.2 -2,-0.4 4,-0.1 -0.690 22.3-129.3 -91.8 147.4 -0.3 2.4 -31.6 26 26 A S S S+ 0 0 61 -23,-0.9 2,-0.3 -2,-0.3 -22,-0.1 0.718 92.1 2.5 -68.5 -22.1 -0.2 -1.1 -30.1 27 27 A Q S S- 0 0 99 41,-0.1 -1,-0.1 -24,-0.1 -2,-0.0 -0.926 105.9 -54.6-154.6 167.3 -0.9 -2.6 -33.6 28 28 A D - 0 0 85 -2,-0.3 41,-0.1 1,-0.1 -2,-0.1 -0.235 41.0-178.7 -53.1 128.0 -1.3 -1.4 -37.3 29 29 A I > - 0 0 2 39,-0.5 3,-2.1 -4,-0.1 62,-0.2 0.240 39.7-122.6-115.0 9.6 -4.0 1.3 -37.6 30 30 A S T 3 S- 0 0 56 1,-0.3 3,-0.1 2,-0.0 39,-0.1 0.829 70.6 -58.9 48.8 44.1 -3.8 1.8 -41.5 31 31 A N T 3 S+ 0 0 61 37,-0.3 2,-2.3 1,-0.2 -1,-0.3 0.420 97.1 141.9 67.1 5.3 -3.1 5.6 -41.1 32 32 A Y < + 0 0 86 -3,-2.1 59,-1.5 18,-0.2 60,-0.4 -0.480 29.2 134.8 -77.5 75.3 -6.4 6.1 -39.2 33 33 A L E -E 90 0B 0 -2,-2.3 18,-2.5 57,-0.2 2,-0.3 -0.996 35.0-168.5-132.2 130.4 -5.0 8.6 -36.8 34 34 A N E -E 89 0B 6 55,-2.9 55,-2.1 -2,-0.4 2,-0.4 -0.875 8.7-150.9-114.2 148.8 -6.4 11.9 -35.6 35 35 A W E -EF 88 48B 0 13,-2.8 12,-2.9 -2,-0.3 13,-1.4 -0.960 17.0-175.7-121.1 136.1 -4.7 14.7 -33.6 36 36 A Y E -EF 87 46B 0 51,-2.1 51,-2.1 -2,-0.4 2,-0.4 -0.964 16.9-146.1-128.9 155.1 -6.6 17.0 -31.3 37 37 A Q E -EF 86 45B 20 8,-2.6 8,-3.1 -2,-0.3 2,-0.4 -0.901 15.7-164.9-117.0 142.0 -5.9 20.0 -29.3 38 38 A Q E -E 85 0B 18 47,-2.9 47,-2.6 -2,-0.4 5,-0.1 -0.978 6.7-174.1-136.6 127.0 -7.6 20.6 -25.9 39 39 A K > - 0 0 75 -2,-0.4 3,-2.0 4,-0.3 45,-0.1 -0.821 46.3 -74.9-110.6 149.4 -7.8 23.8 -23.9 40 40 A P T 3 S+ 0 0 94 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.141 114.6 6.4 -50.4 133.2 -9.3 24.1 -20.3 41 41 A G T 3 S+ 0 0 84 1,-0.2 2,-0.3 -3,-0.0 -3,-0.0 0.337 111.9 102.8 77.8 -3.1 -13.1 24.1 -20.2 42 42 A K S < S- 0 0 149 -3,-2.0 -1,-0.2 1,-0.1 3,-0.1 -0.770 74.3-107.4-116.7 155.9 -13.4 23.4 -23.9 43 43 A A - 0 0 28 -2,-0.3 -4,-0.3 1,-0.1 -6,-0.1 -0.318 52.9 -85.0 -67.2 156.1 -14.2 20.3 -26.2 44 44 A P - 0 0 5 0, 0.0 2,-0.5 0, 0.0 -6,-0.2 -0.334 41.4-143.4 -63.3 149.4 -11.3 18.7 -28.1 45 45 A K E -F 37 0B 106 -8,-3.1 -8,-2.6 -3,-0.1 2,-0.3 -0.978 12.3-127.2-118.3 126.7 -10.5 20.4 -31.5 46 46 A L E +F 36 0B 17 -2,-0.5 -10,-0.3 -10,-0.2 3,-0.1 -0.556 36.7 161.0 -73.8 127.2 -9.5 18.3 -34.5 47 47 A L E + 0 0 2 -12,-2.9 8,-2.3 1,-0.4 2,-0.4 0.753 65.2 26.0-110.8 -46.3 -6.2 19.5 -36.1 48 48 A I E -FG 35 54B 0 -13,-1.4 -13,-2.8 6,-0.2 -1,-0.4 -0.964 62.4-175.8-125.1 140.0 -5.0 16.5 -38.1 49 49 A Y E > + G 0 53B 30 4,-2.6 4,-2.7 -2,-0.4 3,-0.3 -0.926 67.3 18.8-131.3 154.5 -6.9 13.6 -39.6 50 50 A Y T 4 S- 0 0 82 -2,-0.3 2,-2.3 1,-0.2 -18,-0.2 0.899 123.7 -71.2 48.7 50.8 -5.8 10.4 -41.5 51 51 A T T 4 S+ 0 0 5 -18,-2.5 -1,-0.2 1,-0.2 21,-0.2 -0.274 129.1 21.8 69.8 -50.6 -2.2 10.8 -40.1 52 52 A N T 4 S+ 0 0 91 -2,-2.3 2,-0.5 -3,-0.3 12,-0.2 0.187 86.8 114.2-134.6 16.8 -1.2 13.9 -42.2 53 53 A K E < -G 49 0B 103 -4,-2.7 -4,-2.6 10,-0.1 2,-0.5 -0.848 58.9-131.9-102.5 127.5 -4.2 15.8 -43.4 54 54 A L E -G 48 0B 75 -2,-0.5 -6,-0.2 -6,-0.2 3,-0.1 -0.637 25.0-125.3 -75.1 117.6 -4.9 19.4 -42.1 55 55 A A > - 0 0 9 -8,-2.3 3,-1.6 -2,-0.5 262,-0.1 -0.152 42.8 -77.6 -61.2 155.2 -8.6 19.9 -41.0 56 56 A D T 3 S+ 0 0 143 260,-0.4 -1,-0.1 1,-0.2 260,-0.0 -0.350 115.7 8.9 -60.5 129.4 -10.5 22.8 -42.6 57 57 A G T 3 S+ 0 0 72 1,-0.3 -1,-0.2 -3,-0.1 -2,-0.1 0.400 91.2 137.1 80.8 0.7 -9.6 26.2 -41.1 58 58 A V < - 0 0 13 -3,-1.6 -1,-0.3 -11,-0.1 -11,-0.0 -0.610 62.7 -99.3 -79.3 131.9 -6.7 24.9 -39.1 59 59 A P > - 0 0 44 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.219 25.5-117.5 -56.4 145.9 -3.5 27.2 -39.2 60 60 A S T 3 S+ 0 0 121 1,-0.3 16,-0.1 -3,-0.1 -2,-0.0 0.608 103.9 77.4 -53.0 -24.8 -0.7 26.3 -41.6 61 61 A R T 3 S+ 0 0 35 16,-0.1 15,-2.5 14,-0.1 2,-0.3 0.561 80.6 87.8 -68.0 -11.0 1.9 25.8 -38.7 62 62 A F E < +C 75 0A 10 -3,-1.7 2,-0.3 13,-0.2 13,-0.2 -0.726 50.6 151.1 -96.8 141.7 0.3 22.3 -38.0 63 63 A S E -C 74 0A 54 11,-1.9 11,-3.0 -2,-0.3 2,-0.3 -0.957 20.5-159.6-157.7 166.5 1.4 19.0 -39.6 64 64 A G E -C 73 0A 11 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.953 5.6-178.1-147.5 161.3 1.6 15.2 -39.0 65 65 A S E +C 72 0A 64 7,-1.7 7,-3.1 -2,-0.3 2,-0.3 -0.955 9.0 170.4-160.5 148.5 3.4 12.1 -40.4 66 66 A G E -C 71 0A 30 -2,-0.3 2,-0.6 5,-0.3 5,-0.3 -0.871 25.9-155.3-172.2 138.8 3.3 8.3 -39.6 67 67 A S E > -C 70 0A 92 3,-1.6 3,-1.3 -2,-0.3 2,-0.9 -0.844 69.1 -65.1-119.0 89.0 4.5 4.8 -40.7 68 68 A G T 3 S+ 0 0 25 -2,-0.6 -39,-0.5 1,-0.3 -37,-0.3 -0.596 126.1 5.1 74.3-102.5 2.1 2.1 -39.4 69 69 A R T 3 S+ 0 0 117 -2,-0.9 -44,-2.3 -41,-0.1 2,-0.4 0.724 120.6 76.7 -86.0 -26.6 2.3 2.1 -35.6 70 70 A D E < +BC 24 67A 86 -3,-1.3 -3,-1.6 -46,-0.2 2,-0.3 -0.754 58.1 164.6 -92.0 131.4 4.7 5.2 -35.3 71 71 A S E -BC 23 66A 10 -48,-2.7 -48,-3.3 -2,-0.4 2,-0.3 -0.977 15.7-161.1-144.7 154.4 3.2 8.7 -35.8 72 72 A S E -BC 22 65A 19 -7,-3.1 -7,-1.7 -2,-0.3 2,-0.4 -0.967 7.6-152.8-139.0 154.9 4.2 12.4 -35.1 73 73 A F E -BC 21 64A 0 -52,-2.5 -52,-2.5 -2,-0.3 2,-0.4 -0.996 17.8-163.3-128.6 131.4 2.6 15.8 -34.7 74 74 A T E -BC 20 63A 4 -11,-3.0 -11,-1.9 -2,-0.4 2,-0.5 -0.945 21.5-169.3-126.8 140.1 4.4 19.1 -35.5 75 75 A I E -BC 19 62A 0 -56,-2.3 -56,-2.8 -2,-0.4 3,-0.3 -0.997 17.0-159.0-117.4 109.6 3.9 22.9 -34.8 76 76 A S S S+ 0 0 62 -15,-2.5 2,-0.2 -2,-0.5 -14,-0.1 0.725 82.2 11.4 -66.5 -27.2 6.5 24.7 -37.0 77 77 A S S S- 0 0 48 -16,-0.2 -1,-0.3 -59,-0.1 -59,-0.2 -0.765 89.2-127.8-156.5 98.9 6.6 27.9 -34.9 78 78 A L - 0 0 2 -61,-2.1 -62,-2.4 -3,-0.3 2,-0.3 -0.273 20.6-163.2 -58.1 129.8 4.8 27.8 -31.5 79 79 A E > - 0 0 90 -64,-0.2 3,-2.2 -63,-0.1 4,-0.2 -0.813 31.5-115.8-108.2 151.5 2.2 30.4 -30.6 80 80 A S G > S+ 0 0 85 -2,-0.3 3,-1.7 1,-0.3 -1,-0.1 0.842 116.6 61.9 -56.4 -34.2 1.0 31.1 -27.0 81 81 A E G 3 S+ 0 0 106 1,-0.3 -1,-0.3 -3,-0.0 -3,-0.0 0.538 91.9 68.1 -67.6 -9.9 -2.5 29.9 -28.0 82 82 A D G < S+ 0 0 2 -3,-2.2 2,-0.5 2,-0.1 -1,-0.3 0.515 71.0 111.4 -87.3 -8.4 -0.9 26.5 -28.7 83 83 A I < + 0 0 43 -3,-1.7 2,-0.3 -4,-0.2 22,-0.1 -0.607 55.9 73.4 -72.4 114.5 -0.2 25.9 -25.0 84 84 A G S S- 0 0 9 -2,-0.5 20,-2.6 20,-0.2 2,-0.3 -0.944 85.0 -44.5 171.3-159.2 -2.6 23.1 -24.0 85 85 A S E -EH 38 103B 27 -47,-2.6 -47,-2.9 -2,-0.3 2,-0.4 -0.734 39.0-156.8-105.4 148.5 -3.0 19.3 -24.4 86 86 A Y E -EH 37 102B 0 16,-1.8 16,-1.7 -2,-0.3 2,-0.4 -0.993 9.1-171.2-129.4 128.9 -2.6 17.2 -27.5 87 87 A Y E -E 36 0B 17 -51,-2.1 -51,-2.1 -2,-0.4 2,-0.4 -0.952 12.3-151.9-122.0 138.9 -4.2 13.8 -28.0 88 88 A a E -E 35 0B 0 -2,-0.4 11,-2.6 -53,-0.2 2,-0.4 -0.863 19.1-171.9-108.2 140.9 -3.8 11.2 -30.7 89 89 A Q E -EI 34 98B 0 -55,-2.1 -55,-2.9 -2,-0.4 2,-0.4 -0.997 16.8-142.2-139.0 133.6 -6.7 8.9 -31.5 90 90 A Q E +EI 33 97B 0 7,-2.0 7,-0.6 -2,-0.4 -57,-0.2 -0.786 14.3 179.4 -93.5 136.6 -7.1 5.8 -33.7 91 91 A Y + 0 0 38 -59,-1.5 -58,-0.1 -2,-0.4 3,-0.1 -0.097 59.5 97.2-125.2 31.3 -10.4 5.3 -35.7 92 92 A Y S S+ 0 0 122 -60,-0.4 2,-0.3 1,-0.3 -1,-0.1 0.810 92.6 21.2 -85.5 -38.0 -9.4 2.0 -37.3 93 93 A N S S- 0 0 62 2,-0.1 -1,-0.3 4,-0.1 4,-0.2 -1.000 92.3 -94.1-138.9 133.9 -11.2 -0.2 -34.7 94 94 A Y S S+ 0 0 24 -2,-0.3 2,-0.1 -3,-0.1 180,-0.1 -0.744 105.4 58.7 -89.3 134.2 -14.1 0.6 -32.3 95 95 A P S S- 0 0 25 0, 0.0 -93,-0.4 0, 0.0 2,-0.3 0.327 91.7-142.4 -66.5 132.4 -13.7 1.4 -29.4 96 96 A W - 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